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2-nitrobenzothiophene-3-carbonitrile
[CAS# 612505-78-9]

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Identification
Name 2-nitrobenzothiophene-3-carbonitrile
Synonyms 2-nitrobenzo[b]thiophene-3-carbonitrile
Molecular Structure CAS#: 612505-78-9, 2-nitrobenzothiophene-3-carbonitrile
Molecular Formula C9H4N2O2S
Molecular Weight 204.21
CAS Registry Number 612505-78-9
SMILES [O-][N+](=O)c2sc1ccccc1c2C#N
InChI 1S/C9H4N2O2S/c10-5-7-6-3-1-2-4-8(6)14-9(7)11(12)13/h1-4H
InChIKey TXCYUAKLWWCFEH-UHFFFAOYSA-N
Properties
Density 1.498g/cm3 (Cal.)
Boiling point 422.735°C at 760 mmHg (Cal.)
Flash point 209.463°C (Cal.)
Refractive index 1.706 (Cal.)
Safety Data
SDS Available
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